Vitas-M small molecule compound

2-[(4-chlorophenyl)amino]-3,5-dinitrobenzoic acid

Catalog ID
STK673279
SMILES Clc1ccc(cc1)Nc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C13H8ClN3O6 MW 337.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H8ClN3O6/c14-7-1-3-8(4-2-7)15-12-10(13(18)19)5-9(16(20)21)6-11(12)17(22)23/h1-6,15H,(H,18,19)
InChIKey
KEEZFNXQFONMPG-UHFFFAOYSA-N
Synonyms
7240-47-3
2((4chlorophenyl)amino)35dinitrobenzoicacid
2(4CHLOROANILINO)35BISNITROBENZOICACID
2(4CHLOROANILINO)35DINITROBENZOICACID
2(4CHLOROPHENYLAMINO)35DINITROBENZOICACID
7240473
C1=CC(=CC=C1NC2=C(C=C(C=C2C(=O)O)(N+)(=O)(O))(N+)(=O)(O))Cl
Clc1ccc(cc1)Nc1c(cc(cc1(N+)(=O)(O))(N+)(=O)(O))C(=O)O
InChI=1SC13H8ClN3O6c147138(427)151210(13(18)19)59(16(20)21)611(12)17(22)23h1615H(H1819)
MFCD00588460
ZINC000004380479
ZINC4380479

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Available files

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